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ALA3856136 Name:
Mol. Formula:
C114H147N23O36S2
M.W.:
2479.69
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA3856135 Name:
Mol. Formula:
C114H147N23O36S2
M.W.:
2479.69
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA3856134 Name:
Mol. Formula:
C111H149N23O37S
M.W.:
2429.60
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA3856133 Name:
Mol. Formula:
C114H147N23O36S2
M.W.:
2479.69
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA3856132 Name:
Mol. Formula:
C89H117N19O32S2
M.W.:
2029.15
Type:
Protein
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA3856131 Name:
Mol. Formula:
C98H135N19O32S2
M.W.:
2155.39
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA3856130 Name:
Mol. Formula:
C91H121N19O32S2
M.W.:
2057.20
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA3856129 Name:
Mol. Formula:
C111H149N23O36S2
M.W.:
2445.67
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA3856128 Name:
Mol. Formula:
C112H151N23O36S2
M.W.:
2459.70
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA3856127 Name:
Mol. Formula:
C93H125N19O32S2
M.W.:
2085.26
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA3856126 Name:
Mol. Formula:
C95H129N19O32S2
M.W.:
2113.31
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA3856125 Name:
Mol. Formula:
C99H137N19O32S2
M.W.:
2169.42
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA3856124 Name:
Mol. Formula:
C110H147N23O37S
M.W.:
2415.58
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA2144330 Name:
SID103076311
Mol. Formula:
C15H10N4
M.W.:
246.27
Type:
Small molecule
AlogP:
2.94
Polar Surface Area:
43.08
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.52
DETAILS
CLOSE
ALA2138570 Name:
SID103076156
Mol. Formula:
C14H13ClN4O2S
M.W.:
336.80
Type:
Small molecule
AlogP:
3.59
Polar Surface Area:
69.16
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.69
DETAILS
CLOSE
ALA2137289 Name:
SID103163292
Mol. Formula:
C23H20N2O
M.W.:
340.43
Type:
Small molecule
AlogP:
4.84
Polar Surface Area:
41.99
HBA:
2
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.74
DETAILS
CLOSE
ALA2135857 Name:
SID17389435
Mol. Formula:
C7H13NO2
M.W.:
143.19
Type:
Small molecule
AlogP:
0.28
Polar Surface Area:
29.54
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA2133971 Name:
SID103162809
Mol. Formula:
C15H10N4
M.W.:
246.27
Type:
Small molecule
AlogP:
2.94
Polar Surface Area:
43.08
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.52
DETAILS
CLOSE
ALA2133122 Name:
SID99454141
Mol. Formula:
C21H17ClN2O
M.W.:
348.83
Type:
Small molecule
AlogP:
4.85
Polar Surface Area:
41.99
HBA:
2
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.73
DETAILS
CLOSE
ALA1986584 Name:
SID99357375
Mol. Formula:
C27H31N5O8S
M.W.:
585.64
Type:
Small molecule
AlogP:
0.71
Polar Surface Area:
158.04
HBA:
10
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.41
DETAILS
CLOSE
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